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1-Phenylhexane-2,5-dione
SpectraBase Compound ID E8IyJcB0YqZ
InChI InChI=1S/C12H14O2/c1-10(13)7-8-12(14)9-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3
InChIKey UCMOERVVSJLUHT-UHFFFAOYSA-N
Mol Weight 190.24 g/mol
Molecular Formula C12H14O2
Exact Mass 190.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ChL454C1tg
Name 1-Phenylhexane-2,5-dione
CAS Registry Number 32776-14-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O2
InChI InChI=1S/C12H14O2/c1-10(13)7-8-12(14)9-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3
InChIKey UCMOERVVSJLUHT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201100800
Molecular Weight 190.242 g/mol
SMILES C(CCC(=O)Cc1ccccc1)(C)=O
SPLASH splash10-0002-9000000000-fb16a5a233516eda94b0
Source of Spectrum ASC-354-863/SM11-11b
Wiley ID 1762963